#METABOLOMICS WORKBENCH plyush1993_20201020_103059 DATATRACK_ID:2218 STUDY_ID:ST001682 ANALYSIS_ID:AN002746
VERSION                          	1
CREATED_ON                       	05-02-2023
#PROJECT
PR:PROJECT_TITLE                 	Untargeted urine LC-HRMS metabolomics profiling for bladder cancer binary
PR:PROJECT_TITLE                 	outcome classification
PR:PROJECT_SUMMARY               	Two samples cohorts were analysed for bladder cancer biomarkers selection.
PR:PROJECT_SUMMARY               	Untargeted urine RP UPLC-HRMS metabolomics profiling was utilized in SCAN MS
PR:PROJECT_SUMMARY               	mode and positive polarity. Dilute and shoot technique was employed for sample
PR:PROJECT_SUMMARY               	preparation.
PR:INSTITUTE                     	Lomonosov Moscow State University
PR:DEPARTMENT                    	Chemistry
PR:LABORATORY                    	Mass spectrometry
PR:LAST_NAME                     	Plyushchenko
PR:FIRST_NAME                    	Ivan
PR:ADDRESS                       	Leninskie gory, 1/3
PR:EMAIL                         	plyush1993@bk.ru
PR:PHONE                         	+79160362200
PR:FUNDING_SOURCE                	Russian Foundation for Basic Research (RFBR)
PR:PROJECT_COMMENTS              	research project No. 19-33-90071
PR:PUBLICATIONS                  	Ivan V. Plyushchenko, et al. "Omics Untargeted Key Script: R-Based Software
PR:PUBLICATIONS                  	Toolbox for Untargeted Metabolomics with Bladder Cancer Biomarkers Discovery
PR:PUBLICATIONS                  	Case Study" Journal of Proteome Research 2022 21 (3), 833-847. DOI:
PR:PUBLICATIONS                  	10.1021/acs.jproteome.1c00392
PR:DOI                           	http://dx.doi.org/10.21228/M8ZT4C
PR:CONTRIBUTORS                  	Rodin Igor, Glukhov Alexander
#STUDY
ST:STUDY_TITLE                   	Untargeted urine LC-HRMS metabolomics profiling for bladder cancer binary
ST:STUDY_TITLE                   	outcome classification
ST:STUDY_SUMMARY                 	Two samples cohorts were analysed for bladder cancer biomarkers selection.
ST:STUDY_SUMMARY                 	Untargeted urine RP UPLC-HRMS metabolomics profiling was utilized in SCAN MS
ST:STUDY_SUMMARY                 	mode and positive polarity. Dilute and shoot technique was employed for sample
ST:STUDY_SUMMARY                 	preparation.
ST:INSTITUTE                     	Lomonosov MSU
ST:DEPARTMENT                    	Chemistry
ST:LABORATORY                    	Mass spectrometry
ST:LAST_NAME                     	Plyushchenko
ST:FIRST_NAME                    	Ivan
ST:ADDRESS                       	Leninskie gory, 1/3
ST:EMAIL                         	plyush1993@bk.ru
ST:PHONE                         	+79160362200
ST:SUBMIT_DATE                   	2020-10-20
#SUBJECT
SU:SUBJECT_TYPE                  	Human
SU:SUBJECT_SPECIES               	Homo sapiens
SU:TAXONOMY_ID                   	9606
SU:AGE_OR_AGE_RANGE              	19-87
SU:GENDER                        	Male and female
SU:HUMAN_RACE                    	Caucasian
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	-	s4_1	Label:CG | Batch:b1	Run_Order=5; RAW_FILE_NAME=5. s4_1 b1 KMS 10.CDF
SUBJECT_SAMPLE_FACTORS           	-	s4_2	Label:CG | Batch:b1	Run_Order=17; RAW_FILE_NAME=17. s4_2 b1 KMS 10.CDF
SUBJECT_SAMPLE_FACTORS           	-	s6_1	Label:CG | Batch:b1	Run_Order=8; RAW_FILE_NAME=8. s6_1 b1 KMS 11.CDF
SUBJECT_SAMPLE_FACTORS           	-	s6_2	Label:CG | Batch:b1	Run_Order=20; RAW_FILE_NAME=20. s6_2 b1 KMS 11.CDF
SUBJECT_SAMPLE_FACTORS           	-	s9_1	Label:CG | Batch:b1	Run_Order=11; RAW_FILE_NAME=11. s9_1 b1 KMS 52.CDF
SUBJECT_SAMPLE_FACTORS           	-	s9_2	Label:CG | Batch:b1	Run_Order=23; RAW_FILE_NAME=23. s9_2 b1 KMS 52.CDF
SUBJECT_SAMPLE_FACTORS           	-	s91_1	Label:CG | Batch:b10	Run_Order=227; RAW_FILE_NAME=227. s91_1 b10 KMS 12.CDF
SUBJECT_SAMPLE_FACTORS           	-	s91_2	Label:CG | Batch:b10	Run_Order=239; RAW_FILE_NAME=239. s91_2 b10 KMS 12.CDF
SUBJECT_SAMPLE_FACTORS           	-	s93_1	Label:CG | Batch:b10	Run_Order=229; RAW_FILE_NAME=229. s93_1 b10 KMS 46.CDF
SUBJECT_SAMPLE_FACTORS           	-	s93_2	Label:CG | Batch:b10	Run_Order=241; RAW_FILE_NAME=241. s93_2 b10 KMS 46.CDF
SUBJECT_SAMPLE_FACTORS           	-	s94_1	Label:CG | Batch:b10	Run_Order=230; RAW_FILE_NAME=230. s94_1 b10 KMS 32.CDF
SUBJECT_SAMPLE_FACTORS           	-	s94_2	Label:CG | Batch:b10	Run_Order=242; RAW_FILE_NAME=242. s94_2 b10 KMS 32.CDF
SUBJECT_SAMPLE_FACTORS           	-	s95_1	Label:CG | Batch:b10	Run_Order=231; RAW_FILE_NAME=231. s95_1 b10 KMS 4.CDF
SUBJECT_SAMPLE_FACTORS           	-	s95_2	Label:CG | Batch:b10	Run_Order=243; RAW_FILE_NAME=243. s95_2 b10 KMS 4.CDF
SUBJECT_SAMPLE_FACTORS           	-	s96_1	Label:CG | Batch:b10	Run_Order=233; RAW_FILE_NAME=233. s96_1 b10 KMS 49.CDF
SUBJECT_SAMPLE_FACTORS           	-	s96_2	Label:CG | Batch:b10	Run_Order=245; RAW_FILE_NAME=245. s96_2 b10 KMS 49.CDF
SUBJECT_SAMPLE_FACTORS           	-	s105_1	Label:CG | Batch:b11	Run_Order=256; RAW_FILE_NAME=256. s105_1 b11 KMS 28.CDF
SUBJECT_SAMPLE_FACTORS           	-	s105_2	Label:CG | Batch:b11	Run_Order=268; RAW_FILE_NAME=268. s105_2 b11 KMS 28.CDF
SUBJECT_SAMPLE_FACTORS           	-	s109_1	Label:CG | Batch:b11	Run_Order=261; RAW_FILE_NAME=261. s109_1 b11 KMS 55.CDF
SUBJECT_SAMPLE_FACTORS           	-	s109_2	Label:CG | Batch:b11	Run_Order=273; RAW_FILE_NAME=273. s109_2 b11 KMS 55.CDF
SUBJECT_SAMPLE_FACTORS           	-	s112_1	Label:CG | Batch:b12	Run_Order=278; RAW_FILE_NAME=278. s112_1 b12 KMS 15.CDF
SUBJECT_SAMPLE_FACTORS           	-	s112_2	Label:CG | Batch:b12	Run_Order=290; RAW_FILE_NAME=290. s112_2 b12 KMS 15.CDF
SUBJECT_SAMPLE_FACTORS           	-	s116_1	Label:CG | Batch:b12	Run_Order=283; RAW_FILE_NAME=283. s116_1 b12 KMS 37.CDF
SUBJECT_SAMPLE_FACTORS           	-	s116_2	Label:CG | Batch:b12	Run_Order=295; RAW_FILE_NAME=295. s116_2 b12 KMS 37.CDF
SUBJECT_SAMPLE_FACTORS           	-	s117_1	Label:CG | Batch:b12	Run_Order=284; RAW_FILE_NAME=284. s117_1 b12 KMS 50.CDF
SUBJECT_SAMPLE_FACTORS           	-	s117_2	Label:CG | Batch:b12	Run_Order=296; RAW_FILE_NAME=296. s117_2 b12 KMS 50.CDF
SUBJECT_SAMPLE_FACTORS           	-	s120_1	Label:CG | Batch:b12	Run_Order=287; RAW_FILE_NAME=287. s120_1 b12 KMS 34.CDF
SUBJECT_SAMPLE_FACTORS           	-	s120_2	Label:CG | Batch:b12	Run_Order=299; RAW_FILE_NAME=299. s120_2 b12 KMS 34.CDF
SUBJECT_SAMPLE_FACTORS           	-	s124_1	Label:CG | Batch:b13	Run_Order=305; RAW_FILE_NAME=305. s124_1 b13 KMS 43.CDF
SUBJECT_SAMPLE_FACTORS           	-	s124_2	Label:CG | Batch:b13	Run_Order=310; RAW_FILE_NAME=310. s124_2 b13 KMS 43.CDF
SUBJECT_SAMPLE_FACTORS           	-	s11_1	Label:CG | Batch:b2	Run_Order=27; RAW_FILE_NAME=27. s11_1 b2 KMS 51.CDF
SUBJECT_SAMPLE_FACTORS           	-	s11_2	Label:CG | Batch:b2	Run_Order=39; RAW_FILE_NAME=39. s11_2 b2 KMS 51.CDF
SUBJECT_SAMPLE_FACTORS           	-	s13_1	Label:CG | Batch:b2	Run_Order=29; RAW_FILE_NAME=29. s13_1 b2 KMS 9.CDF
SUBJECT_SAMPLE_FACTORS           	-	s13_2	Label:CG | Batch:b2	Run_Order=41; RAW_FILE_NAME=41. s13_2 b2 KMS 9.CDF
SUBJECT_SAMPLE_FACTORS           	-	s14_1	Label:CG | Batch:b2	Run_Order=30; RAW_FILE_NAME=30. s14_1 b2 KMS 56.CDF
SUBJECT_SAMPLE_FACTORS           	-	s14_2	Label:CG | Batch:b2	Run_Order=42; RAW_FILE_NAME=42. s14_2 b2 KMS 56.CDF
SUBJECT_SAMPLE_FACTORS           	-	s18_1	Label:CG | Batch:b2	Run_Order=35; RAW_FILE_NAME=35. s18_1 b2 KMS 42.CDF
SUBJECT_SAMPLE_FACTORS           	-	s18_2	Label:CG | Batch:b2	Run_Order=47; RAW_FILE_NAME=47. s18_2 b2 KMS 42.CDF
SUBJECT_SAMPLE_FACTORS           	-	s19_1	Label:CG | Batch:b2	Run_Order=36; RAW_FILE_NAME=36. s19_1 b2 KMS 31.CDF
SUBJECT_SAMPLE_FACTORS           	-	s19_2	Label:CG | Batch:b2	Run_Order=48; RAW_FILE_NAME=48. s19_2 b2 KMS 31.CDF
SUBJECT_SAMPLE_FACTORS           	-	s20_1	Label:CG | Batch:b2	Run_Order=37; RAW_FILE_NAME=37. s20_1 b2 KMS 40.CDF
SUBJECT_SAMPLE_FACTORS           	-	s20_2	Label:CG | Batch:b2	Run_Order=49; RAW_FILE_NAME=49. s20_2 b2 KMS 40.CDF
SUBJECT_SAMPLE_FACTORS           	-	s21_1	Label:CG | Batch:b3	Run_Order=52; RAW_FILE_NAME=52. s21_1 b3 KMS 29.CDF
SUBJECT_SAMPLE_FACTORS           	-	s21_2	Label:CG | Batch:b3	Run_Order=64; RAW_FILE_NAME=64. s21_2 b3 KMS 29.CDF
SUBJECT_SAMPLE_FACTORS           	-	s23_1	Label:CG | Batch:b3	Run_Order=54; RAW_FILE_NAME=54. s23_1 b3 KMS 36.CDF
SUBJECT_SAMPLE_FACTORS           	-	s23_2	Label:CG | Batch:b3	Run_Order=66; RAW_FILE_NAME=66. s23_2 b3 KMS 36.CDF
SUBJECT_SAMPLE_FACTORS           	-	s25_1	Label:CG | Batch:b3	Run_Order=56; RAW_FILE_NAME=56. s25_1 b3 KMS 25.CDF
SUBJECT_SAMPLE_FACTORS           	-	s25_2	Label:CG | Batch:b3	Run_Order=68; RAW_FILE_NAME=68. s25_2 b3 KMS 25.CDF
SUBJECT_SAMPLE_FACTORS           	-	s27_1	Label:CG | Batch:b3	Run_Order=59; RAW_FILE_NAME=59. s27_1 b3 KMS 27.CDF
SUBJECT_SAMPLE_FACTORS           	-	s27_2	Label:CG | Batch:b3	Run_Order=71; RAW_FILE_NAME=71. s27_2 b3 KMS 27.CDF
SUBJECT_SAMPLE_FACTORS           	-	s29_1	Label:CG | Batch:b3	Run_Order=61; RAW_FILE_NAME=61. s29_1 b3 KMS 58.CDF
SUBJECT_SAMPLE_FACTORS           	-	s29_2	Label:CG | Batch:b3	Run_Order=73; RAW_FILE_NAME=73. s29_2 b3 KMS 58.CDF
SUBJECT_SAMPLE_FACTORS           	-	s33_1	Label:CG | Batch:b4	Run_Order=79; RAW_FILE_NAME=79. s33_1 b4 KMS 59.CDF
SUBJECT_SAMPLE_FACTORS           	-	s33_2	Label:CG | Batch:b4	Run_Order=91; RAW_FILE_NAME=91. s33_2 b4 KMS 59.CDF
SUBJECT_SAMPLE_FACTORS           	-	s36_1	Label:CG | Batch:b4	Run_Order=83; RAW_FILE_NAME=83. s36_1 b4 KMS 44.CDF
SUBJECT_SAMPLE_FACTORS           	-	s36_2	Label:CG | Batch:b4	Run_Order=95; RAW_FILE_NAME=95. s36_2 b4 KMS 44.CDF
SUBJECT_SAMPLE_FACTORS           	-	s37_1	Label:CG | Batch:b4	Run_Order=84; RAW_FILE_NAME=84. s37_1 b4 KMS 1.CDF
SUBJECT_SAMPLE_FACTORS           	-	s37_2	Label:CG | Batch:b4	Run_Order=96; RAW_FILE_NAME=96. s37_2 b4 KMS 1.CDF
SUBJECT_SAMPLE_FACTORS           	-	s41_1	Label:CG | Batch:b5	Run_Order=102; RAW_FILE_NAME=102. s41_1 b5 KMS 2.CDF
SUBJECT_SAMPLE_FACTORS           	-	s41_2	Label:CG | Batch:b5	Run_Order=114; RAW_FILE_NAME=114. s41_2 b5 KMS 2.CDF
SUBJECT_SAMPLE_FACTORS           	-	s42_1	Label:CG | Batch:b5	Run_Order=103; RAW_FILE_NAME=103. s42_1 b5 KMS 48.CDF
SUBJECT_SAMPLE_FACTORS           	-	s42_2	Label:CG | Batch:b5	Run_Order=115; RAW_FILE_NAME=115. s42_2 b5 KMS 48.CDF
SUBJECT_SAMPLE_FACTORS           	-	s45_1	Label:CG | Batch:b5	Run_Order=106; RAW_FILE_NAME=106. s45_1 b5 KMS 21.CDF
SUBJECT_SAMPLE_FACTORS           	-	s45_2	Label:CG | Batch:b5	Run_Order=118; RAW_FILE_NAME=118. s45_2 b5 KMS 21.CDF
SUBJECT_SAMPLE_FACTORS           	-	s46_1	Label:CG | Batch:b5	Run_Order=108; RAW_FILE_NAME=108. s46_1 b5 KMS 3.CDF
SUBJECT_SAMPLE_FACTORS           	-	s46_2	Label:CG | Batch:b5	Run_Order=120; RAW_FILE_NAME=120. s46_2 b5 KMS 3.CDF
SUBJECT_SAMPLE_FACTORS           	-	s48_1	Label:CG | Batch:b5	Run_Order=110; RAW_FILE_NAME=110. s48_1 b5 KMS 54.CDF
SUBJECT_SAMPLE_FACTORS           	-	s48_2	Label:CG | Batch:b5	Run_Order=122; RAW_FILE_NAME=122. s48_2 b5 KMS 54.CDF
SUBJECT_SAMPLE_FACTORS           	-	s50_1	Label:CG | Batch:b5	Run_Order=112; RAW_FILE_NAME=112. s50_1 b5 KMS 8.CDF
SUBJECT_SAMPLE_FACTORS           	-	s50_2	Label:CG | Batch:b5	Run_Order=124; RAW_FILE_NAME=124. s50_2 b5 KMS 8.CDF
SUBJECT_SAMPLE_FACTORS           	-	s51_1	Label:CG | Batch:b6	Run_Order=127; RAW_FILE_NAME=127. s51_1 b6 KMS 19.CDF
SUBJECT_SAMPLE_FACTORS           	-	s51_2	Label:CG | Batch:b6	Run_Order=139; RAW_FILE_NAME=139. s51_2 b6 KMS 19.CDF
SUBJECT_SAMPLE_FACTORS           	-	s52_1	Label:CG | Batch:b6	Run_Order=128; RAW_FILE_NAME=128. s52_1 b6 KMS 47.CDF
SUBJECT_SAMPLE_FACTORS           	-	s52_2	Label:CG | Batch:b6	Run_Order=140; RAW_FILE_NAME=140. s52_2 b6 KMS 47.CDF
SUBJECT_SAMPLE_FACTORS           	-	s55_1	Label:CG | Batch:b6	Run_Order=131; RAW_FILE_NAME=131. s55_1 b6 KMS 26.CDF
SUBJECT_SAMPLE_FACTORS           	-	s55_2	Label:CG | Batch:b6	Run_Order=143; RAW_FILE_NAME=143. s55_2 b6 KMS 26.CDF
SUBJECT_SAMPLE_FACTORS           	-	s59_1	Label:CG | Batch:b6	Run_Order=136; RAW_FILE_NAME=136. s59_1 b6 KMS 33.CDF
SUBJECT_SAMPLE_FACTORS           	-	s59_2	Label:CG | Batch:b6	Run_Order=148; RAW_FILE_NAME=148. s59_2 b6 KMS 33.CDF
SUBJECT_SAMPLE_FACTORS           	-	s60_1	Label:CG | Batch:b6	Run_Order=137; RAW_FILE_NAME=137. s60_1 b6 KMS 38.CDF
SUBJECT_SAMPLE_FACTORS           	-	s60_2	Label:CG | Batch:b6	Run_Order=149; RAW_FILE_NAME=149. s60_2 b6 KMS 38.CDF
SUBJECT_SAMPLE_FACTORS           	-	s61_1	Label:CG | Batch:b7	Run_Order=152; RAW_FILE_NAME=152. s61_1 b7 KMS 60.CDF
SUBJECT_SAMPLE_FACTORS           	-	s61_2	Label:CG | Batch:b7	Run_Order=164; RAW_FILE_NAME=164. s61_2 b7 KMS 60.CDF
SUBJECT_SAMPLE_FACTORS           	-	s63_1	Label:CG | Batch:b7	Run_Order=154; RAW_FILE_NAME=154. s63_1 b7 KMS 41.CDF
SUBJECT_SAMPLE_FACTORS           	-	s63_2	Label:CG | Batch:b7	Run_Order=166; RAW_FILE_NAME=166. s63_2 b7 KMS 41.CDF
SUBJECT_SAMPLE_FACTORS           	-	s65_1	Label:CG | Batch:b7	Run_Order=156; RAW_FILE_NAME=156. s65_1 b7 KMS 5.CDF
SUBJECT_SAMPLE_FACTORS           	-	s65_2	Label:CG | Batch:b7	Run_Order=168; RAW_FILE_NAME=168. s65_2 b7 KMS 5.CDF
SUBJECT_SAMPLE_FACTORS           	-	s67_1	Label:CG | Batch:b7	Run_Order=159; RAW_FILE_NAME=159. s67_1 b7 KMS 35.CDF
SUBJECT_SAMPLE_FACTORS           	-	s67_2	Label:CG | Batch:b7	Run_Order=171; RAW_FILE_NAME=171. s67_2 b7 KMS 35.CDF
SUBJECT_SAMPLE_FACTORS           	-	s69_1	Label:CG | Batch:b7	Run_Order=161; RAW_FILE_NAME=161. s69_1 b7 KMS 23.CDF
SUBJECT_SAMPLE_FACTORS           	-	s69_2	Label:CG | Batch:b7	Run_Order=173; RAW_FILE_NAME=173. s69_2 b7 KMS 23.CDF
SUBJECT_SAMPLE_FACTORS           	-	s70_1	Label:CG | Batch:b7	Run_Order=162; RAW_FILE_NAME=162. s70_1 b7 KMS 30.CDF
SUBJECT_SAMPLE_FACTORS           	-	s70_2	Label:CG | Batch:b7	Run_Order=174; RAW_FILE_NAME=174. s70_2 b7 KMS 30.CDF
SUBJECT_SAMPLE_FACTORS           	-	s71_1	Label:CG | Batch:b8	Run_Order=177; RAW_FILE_NAME=177. s71_1 b8 KMS 17.CDF
SUBJECT_SAMPLE_FACTORS           	-	s71_2	Label:CG | Batch:b8	Run_Order=189; RAW_FILE_NAME=189. s71_2 b8 KMS 17.CDF
SUBJECT_SAMPLE_FACTORS           	-	s73_1	Label:CG | Batch:b8	Run_Order=179; RAW_FILE_NAME=179. s73_1 b8 KMS 24.CDF
SUBJECT_SAMPLE_FACTORS           	-	s73_2	Label:CG | Batch:b8	Run_Order=191; RAW_FILE_NAME=191. s73_2 b8 KMS 24.CDF
SUBJECT_SAMPLE_FACTORS           	-	s74_1	Label:CG | Batch:b8	Run_Order=180; RAW_FILE_NAME=180. s74_1 b8 KMS 6.CDF
SUBJECT_SAMPLE_FACTORS           	-	s74_2	Label:CG | Batch:b8	Run_Order=192; RAW_FILE_NAME=192. s74_2 b8 KMS 6.CDF
SUBJECT_SAMPLE_FACTORS           	-	s77_1	Label:CG | Batch:b8	Run_Order=184; RAW_FILE_NAME=184. s77_1 b8 KMS 13.CDF
SUBJECT_SAMPLE_FACTORS           	-	s77_2	Label:CG | Batch:b8	Run_Order=196; RAW_FILE_NAME=196. s77_2 b8 KMS 13.CDF
SUBJECT_SAMPLE_FACTORS           	-	s78_1	Label:CG | Batch:b8	Run_Order=185; RAW_FILE_NAME=185. s78_1 b8 KMS 53.CDF
SUBJECT_SAMPLE_FACTORS           	-	s78_2	Label:CG | Batch:b8	Run_Order=197; RAW_FILE_NAME=197. s78_2 b8 KMS 53.CDF
SUBJECT_SAMPLE_FACTORS           	-	s79_1	Label:CG | Batch:b8	Run_Order=186; RAW_FILE_NAME=186. s79_1 b8 KMS 14.CDF
SUBJECT_SAMPLE_FACTORS           	-	s79_2	Label:CG | Batch:b8	Run_Order=198; RAW_FILE_NAME=198. s79_2 b8 KMS 14.CDF
SUBJECT_SAMPLE_FACTORS           	-	s80_1	Label:CG | Batch:b8	Run_Order=187; RAW_FILE_NAME=187. s80_1 b8 KMS 57.CDF
SUBJECT_SAMPLE_FACTORS           	-	s80_2	Label:CG | Batch:b8	Run_Order=199; RAW_FILE_NAME=199. s80_2 b8 KMS 57.CDF
SUBJECT_SAMPLE_FACTORS           	-	s81_1	Label:CG | Batch:b9	Run_Order=202; RAW_FILE_NAME=202. s81_1 b9 KMS 20.CDF
SUBJECT_SAMPLE_FACTORS           	-	s81_2	Label:CG | Batch:b9	Run_Order=214; RAW_FILE_NAME=214. s81_2 b9 KMS 20.CDF
SUBJECT_SAMPLE_FACTORS           	-	s82_1	Label:CG | Batch:b9	Run_Order=203; RAW_FILE_NAME=203. s82_1 b9 KMS 45.CDF
SUBJECT_SAMPLE_FACTORS           	-	s82_2	Label:CG | Batch:b9	Run_Order=215; RAW_FILE_NAME=215. s82_2 b9 KMS 45.CDF
SUBJECT_SAMPLE_FACTORS           	-	s84_1	Label:CG | Batch:b9	Run_Order=205; RAW_FILE_NAME=205. s84_1 b9 KMS 16.CDF
SUBJECT_SAMPLE_FACTORS           	-	s84_2	Label:CG | Batch:b9	Run_Order=217; RAW_FILE_NAME=217. s84_2 b9 KMS 16.CDF
SUBJECT_SAMPLE_FACTORS           	-	s85_1	Label:CG | Batch:b9	Run_Order=206; RAW_FILE_NAME=206. s85_1 b9 KMS 22.CDF
SUBJECT_SAMPLE_FACTORS           	-	s85_2	Label:CG | Batch:b9	Run_Order=218; RAW_FILE_NAME=218. s85_2 b9 KMS 22.CDF
SUBJECT_SAMPLE_FACTORS           	-	s86_1	Label:CG | Batch:b9	Run_Order=208; RAW_FILE_NAME=208. s86_1 b9 KMS 39.CDF
SUBJECT_SAMPLE_FACTORS           	-	s86_2	Label:CG | Batch:b9	Run_Order=220; RAW_FILE_NAME=220. s86_2 b9 KMS 39.CDF
SUBJECT_SAMPLE_FACTORS           	-	s88_1	Label:CG | Batch:b9	Run_Order=210; RAW_FILE_NAME=210. s88_1 b9 KMS 18.CDF
SUBJECT_SAMPLE_FACTORS           	-	s88_2	Label:CG | Batch:b9	Run_Order=222; RAW_FILE_NAME=222. s88_2 b9 KMS 18.CDF
SUBJECT_SAMPLE_FACTORS           	-	s90_1	Label:CG | Batch:b9	Run_Order=212; RAW_FILE_NAME=212. s90_1 b9 KMS 7.CDF
SUBJECT_SAMPLE_FACTORS           	-	s90_2	Label:CG | Batch:b9	Run_Order=224; RAW_FILE_NAME=224. s90_2 b9 KMS 7.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc1	Label:QC | Batch:b1	Run_Order=1; RAW_FILE_NAME=1. qc1 b1 QC1.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc2	Label:QC | Batch:b1	Run_Order=7; RAW_FILE_NAME=7. qc2 b1 QC2.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc3	Label:QC | Batch:b1	Run_Order=13; RAW_FILE_NAME=13. qc3 b1 QC3.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc4	Label:QC | Batch:b1	Run_Order=19; RAW_FILE_NAME=19. qc4 b1 QC4.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc5	Label:QC | Batch:b1	Run_Order=25; RAW_FILE_NAME=25. qc5 b1 QC5.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc46	Label:QC | Batch:b10	Run_Order=226; RAW_FILE_NAME=226. qc46 b10 QC46.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc47	Label:QC | Batch:b10	Run_Order=232; RAW_FILE_NAME=232. qc47 b10 QC47.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc48	Label:QC | Batch:b10	Run_Order=238; RAW_FILE_NAME=238. qc48 b10 QC48.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc49	Label:QC | Batch:b10	Run_Order=244; RAW_FILE_NAME=244. qc49 b10 QC49.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc50	Label:QC | Batch:b10	Run_Order=250; RAW_FILE_NAME=250. qc50 b10 QC50.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc51	Label:QC | Batch:b11	Run_Order=251; RAW_FILE_NAME=251. qc51 b11 QC51.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc52	Label:QC | Batch:b11	Run_Order=257; RAW_FILE_NAME=257. qc52 b11 QC52.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc53	Label:QC | Batch:b11	Run_Order=263; RAW_FILE_NAME=263. qc53 b11 QC53.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc54	Label:QC | Batch:b11	Run_Order=269; RAW_FILE_NAME=269. qc54 b11 QC54.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc55	Label:QC | Batch:b11	Run_Order=275; RAW_FILE_NAME=275. qc55 b11 QC55.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc56	Label:QC | Batch:b12	Run_Order=276; RAW_FILE_NAME=276. qc56 b12 QC56.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc57	Label:QC | Batch:b12	Run_Order=282; RAW_FILE_NAME=282. qc57 b12 QC57.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc58	Label:QC | Batch:b12	Run_Order=288; RAW_FILE_NAME=288. qc58 b12 QC58.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc59	Label:QC | Batch:b12	Run_Order=294; RAW_FILE_NAME=294. qc59 b12 QC59.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc60	Label:QC | Batch:b12	Run_Order=300; RAW_FILE_NAME=300. qc60 b12 QC60.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc61	Label:QC | Batch:b13	Run_Order=301; RAW_FILE_NAME=301. qc61 b13 QC61.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc62	Label:QC | Batch:b13	Run_Order=306; RAW_FILE_NAME=306. qc62 b13 QC62.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc63	Label:QC | Batch:b13	Run_Order=311; RAW_FILE_NAME=311. qc63 b13 QC63.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc10	Label:QC | Batch:b2	Run_Order=50; RAW_FILE_NAME=50. qc10 b2 QC10.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc6	Label:QC | Batch:b2	Run_Order=26; RAW_FILE_NAME=26. qc6 b2 QC6.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc7	Label:QC | Batch:b2	Run_Order=32; RAW_FILE_NAME=32. qc7 b2 QC7.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc8	Label:QC | Batch:b2	Run_Order=38; RAW_FILE_NAME=38. qc8 b2 QC8.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc9	Label:QC | Batch:b2	Run_Order=44; RAW_FILE_NAME=44. qc9 b2 QC9.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc11	Label:QC | Batch:b3	Run_Order=51; RAW_FILE_NAME=51. qc11 b3 QC11.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc12	Label:QC | Batch:b3	Run_Order=57; RAW_FILE_NAME=57. qc12 b3 QC12.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc13	Label:QC | Batch:b3	Run_Order=63; RAW_FILE_NAME=63. qc13 b3 QC13.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc14	Label:QC | Batch:b3	Run_Order=69; RAW_FILE_NAME=69. qc14 b3 QC14.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc15	Label:QC | Batch:b3	Run_Order=75; RAW_FILE_NAME=75. qc15 b3 QC15.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc16	Label:QC | Batch:b4	Run_Order=76; RAW_FILE_NAME=76. qc16 b4 QC16.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc17	Label:QC | Batch:b4	Run_Order=82; RAW_FILE_NAME=82. qc17 b4 QC17.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc18	Label:QC | Batch:b4	Run_Order=88; RAW_FILE_NAME=88. qc18 b4 QC18.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc19	Label:QC | Batch:b4	Run_Order=94; RAW_FILE_NAME=94. qc19 b4 QC19.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc20	Label:QC | Batch:b4	Run_Order=100; RAW_FILE_NAME=100. qc20 b4 QC20.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc21	Label:QC | Batch:b5	Run_Order=101; RAW_FILE_NAME=101. qc21 b5 QC21.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc22	Label:QC | Batch:b5	Run_Order=107; RAW_FILE_NAME=107. qc22 b5 QC22.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc23	Label:QC | Batch:b5	Run_Order=113; RAW_FILE_NAME=113. qc23 b5 QC23.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc24	Label:QC | Batch:b5	Run_Order=119; RAW_FILE_NAME=119. qc24 b5 QC24.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc25	Label:QC | Batch:b5	Run_Order=125; RAW_FILE_NAME=125. qc25 b5 QC25.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc26	Label:QC | Batch:b6	Run_Order=126; RAW_FILE_NAME=126. qc26 b6 QC26.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc27	Label:QC | Batch:b6	Run_Order=132; RAW_FILE_NAME=132. qc27 b6 QC27.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc28	Label:QC | Batch:b6	Run_Order=138; RAW_FILE_NAME=138. qc28 b6 QC28.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc29	Label:QC | Batch:b6	Run_Order=144; RAW_FILE_NAME=144. qc29 b6 QC29.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc30	Label:QC | Batch:b6	Run_Order=150; RAW_FILE_NAME=150. qc30 b6 QC30.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc31	Label:QC | Batch:b7	Run_Order=151; RAW_FILE_NAME=151. qc31 b7 QC31.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc32	Label:QC | Batch:b7	Run_Order=157; RAW_FILE_NAME=157. qc32 b7 QC32.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc33	Label:QC | Batch:b7	Run_Order=163; RAW_FILE_NAME=163. qc33 b7 QC33.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc34	Label:QC | Batch:b7	Run_Order=169; RAW_FILE_NAME=169. qc34 b7 QC34.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc35	Label:QC | Batch:b7	Run_Order=175; RAW_FILE_NAME=175. qc35 b7 QC35.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc36	Label:QC | Batch:b8	Run_Order=176; RAW_FILE_NAME=176. qc36 b8 QC36.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc37	Label:QC | Batch:b8	Run_Order=182; RAW_FILE_NAME=182. qc37 b8 QC37.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc38	Label:QC | Batch:b8	Run_Order=188; RAW_FILE_NAME=188. qc38 b8 QC38.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc39	Label:QC | Batch:b8	Run_Order=194; RAW_FILE_NAME=194. qc39 b8 QC39.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc40	Label:QC | Batch:b8	Run_Order=200; RAW_FILE_NAME=200. qc40 b8 QC40.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc41	Label:QC | Batch:b9	Run_Order=201; RAW_FILE_NAME=201. qc41 b9 QC41.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc42	Label:QC | Batch:b9	Run_Order=207; RAW_FILE_NAME=207. qc42 b9 QC42.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc43	Label:QC | Batch:b9	Run_Order=213; RAW_FILE_NAME=213. qc43 b9 QC43.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc44	Label:QC | Batch:b9	Run_Order=219; RAW_FILE_NAME=219. qc44 b9 QC44.CDF
SUBJECT_SAMPLE_FACTORS           	-	qc45	Label:QC | Batch:b9	Run_Order=225; RAW_FILE_NAME=225. qc45 b9 QC45.CDF
SUBJECT_SAMPLE_FACTORS           	-	s10_1	Label:TG | Batch:b1	Run_Order=12; RAW_FILE_NAME=12. s10_1 b1 MS 62.CDF
SUBJECT_SAMPLE_FACTORS           	-	s10_2	Label:TG | Batch:b1	Run_Order=24; RAW_FILE_NAME=24. s10_2 b1 MS 62.CDF
SUBJECT_SAMPLE_FACTORS           	-	s1_1	Label:TG | Batch:b1	Run_Order=2; RAW_FILE_NAME=2. s1_1 b1 MS 39.CDF
SUBJECT_SAMPLE_FACTORS           	-	s1_2	Label:TG | Batch:b1	Run_Order=14; RAW_FILE_NAME=14. s1_2 b1 MS 39.CDF
SUBJECT_SAMPLE_FACTORS           	-	s2_1	Label:TG | Batch:b1	Run_Order=3; RAW_FILE_NAME=3. s2_1 b1 MS 26.CDF
SUBJECT_SAMPLE_FACTORS           	-	s2_2	Label:TG | Batch:b1	Run_Order=15; RAW_FILE_NAME=15. s2_2 b1 MS 26.CDF
SUBJECT_SAMPLE_FACTORS           	-	s3_1	Label:TG | Batch:b1	Run_Order=4; RAW_FILE_NAME=4. s3_1 b1 MS 28.CDF
SUBJECT_SAMPLE_FACTORS           	-	s3_2	Label:TG | Batch:b1	Run_Order=16; RAW_FILE_NAME=16. s3_2 b1 MS 28.CDF
SUBJECT_SAMPLE_FACTORS           	-	s5_1	Label:TG | Batch:b1	Run_Order=6; RAW_FILE_NAME=6. s5_1 b1 MS 20.CDF
SUBJECT_SAMPLE_FACTORS           	-	s5_2	Label:TG | Batch:b1	Run_Order=18; RAW_FILE_NAME=18. s5_2 b1 MS 20.CDF
SUBJECT_SAMPLE_FACTORS           	-	s7_1	Label:TG | Batch:b1	Run_Order=9; RAW_FILE_NAME=9. s7_1 b1 MS 33.CDF
SUBJECT_SAMPLE_FACTORS           	-	s7_2	Label:TG | Batch:b1	Run_Order=21; RAW_FILE_NAME=21. s7_2 b1 MS 33.CDF
SUBJECT_SAMPLE_FACTORS           	-	s8_1	Label:TG | Batch:b1	Run_Order=10; RAW_FILE_NAME=10. s8_1 b1 MS 11.CDF
SUBJECT_SAMPLE_FACTORS           	-	s8_2	Label:TG | Batch:b1	Run_Order=22; RAW_FILE_NAME=22. s8_2 b1 MS 11.CDF
SUBJECT_SAMPLE_FACTORS           	-	s100_1	Label:TG | Batch:b10	Run_Order=237; RAW_FILE_NAME=237. s100_1 b10 MS 37.CDF
SUBJECT_SAMPLE_FACTORS           	-	s100_2	Label:TG | Batch:b10	Run_Order=249; RAW_FILE_NAME=249. s100_2 b10 MS 37.CDF
SUBJECT_SAMPLE_FACTORS           	-	s92_1	Label:TG | Batch:b10	Run_Order=228; RAW_FILE_NAME=228. s92_1 b10 MS 32.CDF
SUBJECT_SAMPLE_FACTORS           	-	s92_2	Label:TG | Batch:b10	Run_Order=240; RAW_FILE_NAME=240. s92_2 b10 MS 32.CDF
SUBJECT_SAMPLE_FACTORS           	-	s97_1	Label:TG | Batch:b10	Run_Order=234; RAW_FILE_NAME=234. s97_1 b10 MS 6.CDF
SUBJECT_SAMPLE_FACTORS           	-	s97_2	Label:TG | Batch:b10	Run_Order=246; RAW_FILE_NAME=246. s97_2 b10 MS 6.CDF
SUBJECT_SAMPLE_FACTORS           	-	s98_1	Label:TG | Batch:b10	Run_Order=235; RAW_FILE_NAME=235. s98_1 b10 MS 53.CDF
SUBJECT_SAMPLE_FACTORS           	-	s98_2	Label:TG | Batch:b10	Run_Order=247; RAW_FILE_NAME=247. s98_2 b10 MS 53.CDF
SUBJECT_SAMPLE_FACTORS           	-	s99_1	Label:TG | Batch:b10	Run_Order=236; RAW_FILE_NAME=236. s99_1 b10 MS 10.CDF
SUBJECT_SAMPLE_FACTORS           	-	s99_2	Label:TG | Batch:b10	Run_Order=248; RAW_FILE_NAME=248. s99_2 b10 MS 10.CDF
SUBJECT_SAMPLE_FACTORS           	-	s101_1	Label:TG | Batch:b11	Run_Order=252; RAW_FILE_NAME=252. s101_1 b11 MS 23.CDF
SUBJECT_SAMPLE_FACTORS           	-	s101_2	Label:TG | Batch:b11	Run_Order=264; RAW_FILE_NAME=264. s101_2 b11 MS 23.CDF
SUBJECT_SAMPLE_FACTORS           	-	s102_1	Label:TG | Batch:b11	Run_Order=253; RAW_FILE_NAME=253. s102_1 b11 MS 36.CDF
SUBJECT_SAMPLE_FACTORS           	-	s102_2	Label:TG | Batch:b11	Run_Order=265; RAW_FILE_NAME=265. s102_2 b11 MS 36.CDF
SUBJECT_SAMPLE_FACTORS           	-	s103_1	Label:TG | Batch:b11	Run_Order=254; RAW_FILE_NAME=254. s103_1 b11 MS 56.CDF
SUBJECT_SAMPLE_FACTORS           	-	s103_2	Label:TG | Batch:b11	Run_Order=266; RAW_FILE_NAME=266. s103_2 b11 MS 56.CDF
SUBJECT_SAMPLE_FACTORS           	-	s104_1	Label:TG | Batch:b11	Run_Order=255; RAW_FILE_NAME=255. s104_1 b11 MS 15.CDF
SUBJECT_SAMPLE_FACTORS           	-	s104_2	Label:TG | Batch:b11	Run_Order=267; RAW_FILE_NAME=267. s104_2 b11 MS 15.CDF
SUBJECT_SAMPLE_FACTORS           	-	s106_1	Label:TG | Batch:b11	Run_Order=258; RAW_FILE_NAME=258. s106_1 b11 MS 48.CDF
SUBJECT_SAMPLE_FACTORS           	-	s106_2	Label:TG | Batch:b11	Run_Order=270; RAW_FILE_NAME=270. s106_2 b11 MS 48.CDF
SUBJECT_SAMPLE_FACTORS           	-	s107_1	Label:TG | Batch:b11	Run_Order=259; RAW_FILE_NAME=259. s107_1 b11 MS 61.CDF
SUBJECT_SAMPLE_FACTORS           	-	s107_2	Label:TG | Batch:b11	Run_Order=271; RAW_FILE_NAME=271. s107_2 b11 MS 61.CDF
SUBJECT_SAMPLE_FACTORS           	-	s108_1	Label:TG | Batch:b11	Run_Order=260; RAW_FILE_NAME=260. s108_1 b11 MS 25.CDF
SUBJECT_SAMPLE_FACTORS           	-	s108_2	Label:TG | Batch:b11	Run_Order=272; RAW_FILE_NAME=272. s108_2 b11 MS 25.CDF
SUBJECT_SAMPLE_FACTORS           	-	s110_1	Label:TG | Batch:b11	Run_Order=262; RAW_FILE_NAME=262. s110_1 b11 MS 21.CDF
SUBJECT_SAMPLE_FACTORS           	-	s110_2	Label:TG | Batch:b11	Run_Order=274; RAW_FILE_NAME=274. s110_2 b11 MS 21.CDF
SUBJECT_SAMPLE_FACTORS           	-	s111_1	Label:TG | Batch:b12	Run_Order=277; RAW_FILE_NAME=277. s111_1 b12 MS 2.CDF
SUBJECT_SAMPLE_FACTORS           	-	s111_2	Label:TG | Batch:b12	Run_Order=289; RAW_FILE_NAME=289. s111_2 b12 MS 2.CDF
SUBJECT_SAMPLE_FACTORS           	-	s113_1	Label:TG | Batch:b12	Run_Order=279; RAW_FILE_NAME=279. s113_1 b12 MS 52.CDF
SUBJECT_SAMPLE_FACTORS           	-	s113_2	Label:TG | Batch:b12	Run_Order=291; RAW_FILE_NAME=291. s113_2 b12 MS 52.CDF
SUBJECT_SAMPLE_FACTORS           	-	s114_1	Label:TG | Batch:b12	Run_Order=280; RAW_FILE_NAME=280. s114_1 b12 MS 57.CDF
SUBJECT_SAMPLE_FACTORS           	-	s114_2	Label:TG | Batch:b12	Run_Order=292; RAW_FILE_NAME=292. s114_2 b12 MS 57.CDF
SUBJECT_SAMPLE_FACTORS           	-	s115_1	Label:TG | Batch:b12	Run_Order=281; RAW_FILE_NAME=281. s115_1 b12 MS 40.CDF
SUBJECT_SAMPLE_FACTORS           	-	s115_2	Label:TG | Batch:b12	Run_Order=293; RAW_FILE_NAME=293. s115_2 b12 MS 40.CDF
SUBJECT_SAMPLE_FACTORS           	-	s118_1	Label:TG | Batch:b12	Run_Order=285; RAW_FILE_NAME=285. s118_1 b12 MS 44.CDF
SUBJECT_SAMPLE_FACTORS           	-	s118_2	Label:TG | Batch:b12	Run_Order=297; RAW_FILE_NAME=297. s118_2 b12 MS 44.CDF
SUBJECT_SAMPLE_FACTORS           	-	s119_1	Label:TG | Batch:b12	Run_Order=286; RAW_FILE_NAME=286. s119_1 b12 MS 50.CDF
SUBJECT_SAMPLE_FACTORS           	-	s119_2	Label:TG | Batch:b12	Run_Order=298; RAW_FILE_NAME=298. s119_2 b12 MS 50.CDF
SUBJECT_SAMPLE_FACTORS           	-	s121_1	Label:TG | Batch:b13	Run_Order=302; RAW_FILE_NAME=302. s121_1 b13 MS 19.CDF
SUBJECT_SAMPLE_FACTORS           	-	s121_2	Label:TG | Batch:b13	Run_Order=307; RAW_FILE_NAME=307. s121_2 b13 MS 19.CDF
SUBJECT_SAMPLE_FACTORS           	-	s122_1	Label:TG | Batch:b13	Run_Order=303; RAW_FILE_NAME=303. s122_1 b13 MS 64.CDF
SUBJECT_SAMPLE_FACTORS           	-	s122_2	Label:TG | Batch:b13	Run_Order=308; RAW_FILE_NAME=308. s122_2 b13 MS 64.CDF
SUBJECT_SAMPLE_FACTORS           	-	s123_1	Label:TG | Batch:b13	Run_Order=304; RAW_FILE_NAME=304. s123_1 b13 MS 1.CDF
SUBJECT_SAMPLE_FACTORS           	-	s123_2	Label:TG | Batch:b13	Run_Order=309; RAW_FILE_NAME=309. s123_2 b13 MS 1.CDF
SUBJECT_SAMPLE_FACTORS           	-	s12_1	Label:TG | Batch:b2	Run_Order=28; RAW_FILE_NAME=28. s12_1 b2 MS 41.CDF
SUBJECT_SAMPLE_FACTORS           	-	s12_2	Label:TG | Batch:b2	Run_Order=40; RAW_FILE_NAME=40. s12_2 b2 MS 41.CDF
SUBJECT_SAMPLE_FACTORS           	-	s15_1	Label:TG | Batch:b2	Run_Order=31; RAW_FILE_NAME=31. s15_1 b2 MS 9.CDF
SUBJECT_SAMPLE_FACTORS           	-	s15_2	Label:TG | Batch:b2	Run_Order=43; RAW_FILE_NAME=43. s15_2 b2 MS 9.CDF
SUBJECT_SAMPLE_FACTORS           	-	s16_1	Label:TG | Batch:b2	Run_Order=33; RAW_FILE_NAME=33. s16_1 b2 MS 60.CDF
SUBJECT_SAMPLE_FACTORS           	-	s16_2	Label:TG | Batch:b2	Run_Order=45; RAW_FILE_NAME=45. s16_2 b2 MS 60.CDF
SUBJECT_SAMPLE_FACTORS           	-	s17_1	Label:TG | Batch:b2	Run_Order=34; RAW_FILE_NAME=34. s17_1 b2 MS 43.CDF
SUBJECT_SAMPLE_FACTORS           	-	s17_2	Label:TG | Batch:b2	Run_Order=46; RAW_FILE_NAME=46. s17_2 b2 MS 43.CDF
SUBJECT_SAMPLE_FACTORS           	-	s22_1	Label:TG | Batch:b3	Run_Order=53; RAW_FILE_NAME=53. s22_1 b3 MS 22.CDF
SUBJECT_SAMPLE_FACTORS           	-	s22_2	Label:TG | Batch:b3	Run_Order=65; RAW_FILE_NAME=65. s22_2 b3 MS 22.CDF
SUBJECT_SAMPLE_FACTORS           	-	s24_1	Label:TG | Batch:b3	Run_Order=55; RAW_FILE_NAME=55. s24_1 b3 MS 30.CDF
SUBJECT_SAMPLE_FACTORS           	-	s24_2	Label:TG | Batch:b3	Run_Order=67; RAW_FILE_NAME=67. s24_2 b3 MS 30.CDF
SUBJECT_SAMPLE_FACTORS           	-	s26_1	Label:TG | Batch:b3	Run_Order=58; RAW_FILE_NAME=58. s26_1 b3 MS 46.CDF
SUBJECT_SAMPLE_FACTORS           	-	s26_2	Label:TG | Batch:b3	Run_Order=70; RAW_FILE_NAME=70. s26_2 b3 MS 46.CDF
SUBJECT_SAMPLE_FACTORS           	-	s28_1	Label:TG | Batch:b3	Run_Order=60; RAW_FILE_NAME=60. s28_1 b3 MS 7.CDF
SUBJECT_SAMPLE_FACTORS           	-	s28_2	Label:TG | Batch:b3	Run_Order=72; RAW_FILE_NAME=72. s28_2 b3 MS 7.CDF
SUBJECT_SAMPLE_FACTORS           	-	s30_1	Label:TG | Batch:b3	Run_Order=62; RAW_FILE_NAME=62. s30_1 b3 MS 42.CDF
SUBJECT_SAMPLE_FACTORS           	-	s30_2	Label:TG | Batch:b3	Run_Order=74; RAW_FILE_NAME=74. s30_2 b3 MS 42.CDF
SUBJECT_SAMPLE_FACTORS           	-	s31_1	Label:TG | Batch:b4	Run_Order=77; RAW_FILE_NAME=77. s31_1 b4 MS 5.CDF
SUBJECT_SAMPLE_FACTORS           	-	s31_2	Label:TG | Batch:b4	Run_Order=89; RAW_FILE_NAME=89. s31_2 b4 MS 5.CDF
SUBJECT_SAMPLE_FACTORS           	-	s32_1	Label:TG | Batch:b4	Run_Order=78; RAW_FILE_NAME=78. s32_1 b4 MS 55.CDF
SUBJECT_SAMPLE_FACTORS           	-	s32_2	Label:TG | Batch:b4	Run_Order=90; RAW_FILE_NAME=90. s32_2 b4 MS 55.CDF
SUBJECT_SAMPLE_FACTORS           	-	s34_1	Label:TG | Batch:b4	Run_Order=80; RAW_FILE_NAME=80. s34_1 b4 MS 12.CDF
SUBJECT_SAMPLE_FACTORS           	-	s34_2	Label:TG | Batch:b4	Run_Order=92; RAW_FILE_NAME=92. s34_2 b4 MS 12.CDF
SUBJECT_SAMPLE_FACTORS           	-	s35_1	Label:TG | Batch:b4	Run_Order=81; RAW_FILE_NAME=81. s35_1 b4 MS 29.CDF
SUBJECT_SAMPLE_FACTORS           	-	s35_2	Label:TG | Batch:b4	Run_Order=93; RAW_FILE_NAME=93. s35_2 b4 MS 29.CDF
SUBJECT_SAMPLE_FACTORS           	-	s38_1	Label:TG | Batch:b4	Run_Order=85; RAW_FILE_NAME=85. s38_1 b4 MS 27.CDF
SUBJECT_SAMPLE_FACTORS           	-	s38_2	Label:TG | Batch:b4	Run_Order=97; RAW_FILE_NAME=97. s38_2 b4 MS 27.CDF
SUBJECT_SAMPLE_FACTORS           	-	s39_1	Label:TG | Batch:b4	Run_Order=86; RAW_FILE_NAME=86. s39_1 b4 MS 31.CDF
SUBJECT_SAMPLE_FACTORS           	-	s39_2	Label:TG | Batch:b4	Run_Order=98; RAW_FILE_NAME=98. s39_2 b4 MS 31.CDF
SUBJECT_SAMPLE_FACTORS           	-	s40_1	Label:TG | Batch:b4	Run_Order=87; RAW_FILE_NAME=87. s40_1 b4 MS 58.CDF
SUBJECT_SAMPLE_FACTORS           	-	s40_2	Label:TG | Batch:b4	Run_Order=99; RAW_FILE_NAME=99. s40_2 b4 MS 58.CDF
SUBJECT_SAMPLE_FACTORS           	-	s43_1	Label:TG | Batch:b5	Run_Order=104; RAW_FILE_NAME=104. s43_1 b5 MS 47.CDF
SUBJECT_SAMPLE_FACTORS           	-	s43_2	Label:TG | Batch:b5	Run_Order=116; RAW_FILE_NAME=116. s43_2 b5 MS 47.CDF
SUBJECT_SAMPLE_FACTORS           	-	s44_1	Label:TG | Batch:b5	Run_Order=105; RAW_FILE_NAME=105. s44_1 b5 MS 4.CDF
SUBJECT_SAMPLE_FACTORS           	-	s44_2	Label:TG | Batch:b5	Run_Order=117; RAW_FILE_NAME=117. s44_2 b5 MS 4.CDF
SUBJECT_SAMPLE_FACTORS           	-	s47_1	Label:TG | Batch:b5	Run_Order=109; RAW_FILE_NAME=109. s47_1 b5 MS 3.CDF
SUBJECT_SAMPLE_FACTORS           	-	s47_2	Label:TG | Batch:b5	Run_Order=121; RAW_FILE_NAME=121. s47_2 b5 MS 3.CDF
SUBJECT_SAMPLE_FACTORS           	-	s49_1	Label:TG | Batch:b5	Run_Order=111; RAW_FILE_NAME=111. s49_1 b5 MS 34.CDF
SUBJECT_SAMPLE_FACTORS           	-	s49_2	Label:TG | Batch:b5	Run_Order=123; RAW_FILE_NAME=123. s49_2 b5 MS 34.CDF
SUBJECT_SAMPLE_FACTORS           	-	s53_1	Label:TG | Batch:b6	Run_Order=129; RAW_FILE_NAME=129. s53_1 b6 MS 54.CDF
SUBJECT_SAMPLE_FACTORS           	-	s53_2	Label:TG | Batch:b6	Run_Order=141; RAW_FILE_NAME=141. s53_2 b6 MS 54.CDF
SUBJECT_SAMPLE_FACTORS           	-	s54_1	Label:TG | Batch:b6	Run_Order=130; RAW_FILE_NAME=130. s54_1 b6 MS 63.CDF
SUBJECT_SAMPLE_FACTORS           	-	s54_2	Label:TG | Batch:b6	Run_Order=142; RAW_FILE_NAME=142. s54_2 b6 MS 63.CDF
SUBJECT_SAMPLE_FACTORS           	-	s56_1	Label:TG | Batch:b6	Run_Order=133; RAW_FILE_NAME=133. s56_1 b6 MS 8.CDF
SUBJECT_SAMPLE_FACTORS           	-	s56_2	Label:TG | Batch:b6	Run_Order=145; RAW_FILE_NAME=145. s56_2 b6 MS 8.CDF
SUBJECT_SAMPLE_FACTORS           	-	s57_1	Label:TG | Batch:b6	Run_Order=134; RAW_FILE_NAME=134. s57_1 b6 MS 18.CDF
SUBJECT_SAMPLE_FACTORS           	-	s57_2	Label:TG | Batch:b6	Run_Order=146; RAW_FILE_NAME=146. s57_2 b6 MS 18.CDF
SUBJECT_SAMPLE_FACTORS           	-	s58_1	Label:TG | Batch:b6	Run_Order=135; RAW_FILE_NAME=135. s58_1 b6 MS 51.CDF
SUBJECT_SAMPLE_FACTORS           	-	s58_2	Label:TG | Batch:b6	Run_Order=147; RAW_FILE_NAME=147. s58_2 b6 MS 51.CDF
SUBJECT_SAMPLE_FACTORS           	-	s62_1	Label:TG | Batch:b7	Run_Order=153; RAW_FILE_NAME=153. s62_1 b7 MS 35.CDF
SUBJECT_SAMPLE_FACTORS           	-	s62_2	Label:TG | Batch:b7	Run_Order=165; RAW_FILE_NAME=165. s62_2 b7 MS 35.CDF
SUBJECT_SAMPLE_FACTORS           	-	s64_1	Label:TG | Batch:b7	Run_Order=155; RAW_FILE_NAME=155. s64_1 b7 MS 45.CDF
SUBJECT_SAMPLE_FACTORS           	-	s64_2	Label:TG | Batch:b7	Run_Order=167; RAW_FILE_NAME=167. s64_2 b7 MS 45.CDF
SUBJECT_SAMPLE_FACTORS           	-	s66_1	Label:TG | Batch:b7	Run_Order=158; RAW_FILE_NAME=158. s66_1 b7 MS 49.CDF
SUBJECT_SAMPLE_FACTORS           	-	s66_2	Label:TG | Batch:b7	Run_Order=170; RAW_FILE_NAME=170. s66_2 b7 MS 49.CDF
SUBJECT_SAMPLE_FACTORS           	-	s68_1	Label:TG | Batch:b7	Run_Order=160; RAW_FILE_NAME=160. s68_1 b7 MS 24.CDF
SUBJECT_SAMPLE_FACTORS           	-	s68_2	Label:TG | Batch:b7	Run_Order=172; RAW_FILE_NAME=172. s68_2 b7 MS 24.CDF
SUBJECT_SAMPLE_FACTORS           	-	s72_1	Label:TG | Batch:b8	Run_Order=178; RAW_FILE_NAME=178. s72_1 b8 MS 38.CDF
SUBJECT_SAMPLE_FACTORS           	-	s72_2	Label:TG | Batch:b8	Run_Order=190; RAW_FILE_NAME=190. s72_2 b8 MS 38.CDF
SUBJECT_SAMPLE_FACTORS           	-	s75_1	Label:TG | Batch:b8	Run_Order=181; RAW_FILE_NAME=181. s75_1 b8 MS 16.CDF
SUBJECT_SAMPLE_FACTORS           	-	s75_2	Label:TG | Batch:b8	Run_Order=193; RAW_FILE_NAME=193. s75_2 b8 MS 16.CDF
SUBJECT_SAMPLE_FACTORS           	-	s76_1	Label:TG | Batch:b8	Run_Order=183; RAW_FILE_NAME=183. s76_1 b8 MS 14.CDF
SUBJECT_SAMPLE_FACTORS           	-	s76_2	Label:TG | Batch:b8	Run_Order=195; RAW_FILE_NAME=195. s76_2 b8 MS 14.CDF
SUBJECT_SAMPLE_FACTORS           	-	s83_1	Label:TG | Batch:b9	Run_Order=204; RAW_FILE_NAME=204. s83_1 b9 MS 59.CDF
SUBJECT_SAMPLE_FACTORS           	-	s83_2	Label:TG | Batch:b9	Run_Order=216; RAW_FILE_NAME=216. s83_2 b9 MS 59.CDF
SUBJECT_SAMPLE_FACTORS           	-	s87_1	Label:TG | Batch:b9	Run_Order=209; RAW_FILE_NAME=209. s87_1 b9 MS 13.CDF
SUBJECT_SAMPLE_FACTORS           	-	s87_2	Label:TG | Batch:b9	Run_Order=221; RAW_FILE_NAME=221. s87_2 b9 MS 13.CDF
SUBJECT_SAMPLE_FACTORS           	-	s89_1	Label:TG | Batch:b9	Run_Order=211; RAW_FILE_NAME=211. s89_1 b9 MS 17.CDF
SUBJECT_SAMPLE_FACTORS           	-	s89_2	Label:TG | Batch:b9	Run_Order=223; RAW_FILE_NAME=223. s89_2 b9 MS 17.CDF
#COLLECTION
CO:COLLECTION_SUMMARY            	All morning fasting urine samples were collected in sterilized plastic sealed
CO:COLLECTION_SUMMARY            	falcons for this study and were frozen in the refrigerator at -80 °C. All the
CO:COLLECTION_SUMMARY            	samples were defrosted at room temperature prior the analysis. The quality
CO:COLLECTION_SUMMARY            	control (QC) sample was prepared from a mix of all urine samples that were
CO:COLLECTION_SUMMARY            	participated in this research in equal volume, then were filled into separate
CO:COLLECTION_SUMMARY            	containers and were stored together with other samples. A new aliquot (from
CO:COLLECTION_SUMMARY            	individual container) of QC was used in each new day of analysis.
CO:SAMPLE_TYPE                   	Urine
CO:STORAGE_CONDITIONS            	-80℃
#TREATMENT
TR:TREATMENT_SUMMARY             	Creatinine level, age, sex and clinical diagnosis were collected for study
TR:TREATMENT_SUMMARY             	samples as meta-data. The study included urine samples from patients with
TR:TREATMENT_SUMMARY             	bladder cancer (TG) and healthy controls (CG) matched with the TG group for age
TR:TREATMENT_SUMMARY             	and sex.
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Briefly, dilute and shoot technique was utilized. Prior to analysis, samples
SP:SAMPLEPREP_SUMMARY            	were defrosted at room temperature and vortexed vigorously and centrifuged at
SP:SAMPLEPREP_SUMMARY            	16000 rpm for 15 min, then aliquots of the supernatant were diluted in 5-fold by
SP:SAMPLEPREP_SUMMARY            	deionized water with a final papaverine concentration of 0.2 µg mL-1 (IS),
SP:SAMPLEPREP_SUMMARY            	vortexed vigorously and centrifuged at 16000 rpm for 15 min and then aliquots of
SP:SAMPLEPREP_SUMMARY            	supernatant were placed into vials.
SP:PROCESSING_STORAGE_CONDITIONS 	Room temperature
SP:EXTRACT_STORAGE               	Room temperature
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	The apparatus consisted of a two LC-20AD pumps (Shimadzu, Japan), an automatic
CH:CHROMATOGRAPHY_SUMMARY        	sample injector, coupled on-line with an LCMS-IT-TOF (Shimadzu, Japan) mass
CH:CHROMATOGRAPHY_SUMMARY        	spectrometer with an electrospray ionization source. The HPLC separation was
CH:CHROMATOGRAPHY_SUMMARY        	conducted on a 2.1 × 100 mm Waters Acquity UPLC BEH; 1.7 μm column (Waters,
CH:CHROMATOGRAPHY_SUMMARY        	Milford MA, USA) with 2.1 × 5 mm UHPLC Guard 3PK Zorbax SB-C18 1.8 μm guard
CH:CHROMATOGRAPHY_SUMMARY        	column (Agilent Technologies, USA). Two solvents were used: (A) deionized water
CH:CHROMATOGRAPHY_SUMMARY        	with 0,1% formic acid, and (B) MeCN. After a 5 min hold at 5% solvent B, elution
CH:CHROMATOGRAPHY_SUMMARY        	was performed according to the following conditions: from 5% B to 40% B in 20
CH:CHROMATOGRAPHY_SUMMARY        	min; to 95% B in 7 min; keeping constant for 10 min, to 5% B in 3 min, followed
CH:CHROMATOGRAPHY_SUMMARY        	by 5 min of equilibration on the initial conditions. Total analysis time was 50
CH:CHROMATOGRAPHY_SUMMARY        	min. Column temperature was 35˚C. Autosampler tray temperature was 4˚C.
CH:INSTRUMENT_NAME               	Shimadzu 20AD
CH:COLUMN_NAME                   	Waters Acquity BEH C18 (100 x 2mm,1.7um)
CH:COLUMN_PRESSURE               	300-500 bar
CH:COLUMN_TEMPERATURE            	35
CH:FLOW_GRADIENT                 	non-linear
CH:FLOW_RATE                     	0.3 ml/min
CH:INJECTION_TEMPERATURE         	5
CH:INTERNAL_STANDARD             	papaverine
CH:SAMPLE_INJECTION              	5 mkl
CH:SOLVENT_A                     	100% water; 0.1% formic acid
CH:SOLVENT_B                     	100% acetonitrile
CH:ANALYTICAL_TIME               	50 min
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
AN:SOFTWARE_VERSION              	LabSolution 3.80.410
AN:DATA_FORMAT                   	.lcd and .CDF
#MS
MS:INSTRUMENT_NAME               	Shimadzu LCMS-IT-TOF
MS:INSTRUMENT_TYPE               	Other
MS:MS_TYPE                       	ESI
MS:MS_COMMENTS                   	The apparatus consisted of a two LC-20AD pumps (Shimadzu, Japan), an automatic
MS:MS_COMMENTS                   	sample injector, coupled on-line with an LCMS-IT-TOF (Shimadzu, Japan) mass
MS:MS_COMMENTS                   	spectrometer. The column effluent was analyzed by ESI-MS. MS detection was
MS:MS_COMMENTS                   	operated in positive ionisation mode with the following parameters: detector
MS:MS_COMMENTS                   	voltage, 1.53 kV; interface voltage, +4.5 kV; CDL (curve desolvation line)
MS:MS_COMMENTS                   	temperature, 200 ˚C; block heater temperature, 200 ˚C; nebulizing gas flow
MS:MS_COMMENTS                   	(He), 1.5 L/min; drying gas pressure, 100 kPa. Full scan MS data were acquired
MS:MS_COMMENTS                   	in the range of 80–850 m/z (ion accumulation time, 30 ms; event time, 300 ms;
MS:MS_COMMENTS                   	repeat = 3.
MS:ION_MODE                      	POSITIVE
MS:CAPILLARY_VOLTAGE             	+4.5 kV
MS:DRY_GAS_FLOW                  	100 kPa
MS:HELIUM_FLOW                   	1.5 ml/min
MS:ION_SOURCE_TEMPERATURE        	200 ˚C
MS:IONIZATION                    	positive
MS:MASS_ACCURACY                 	15 ppm
MS:SOURCE_TEMPERATURE            	200 ˚C
MS:CDL_TEMPERATURE               	200 ˚C
MS:MS_RESULTS_FILE               	ST001682_AN002746_Results.txt	UNITS:area	Has m/z:Yes	Has RT:Yes	RT units:Seconds
#END